PUBCHEM-ZINC04703676 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 0 0 0 0 0 0999 V2000 0.4700 1.7010 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3630 0.2070 -0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 -0.5810 0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 -1.9740 0.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 -2.6040 -0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1630 -1.8120 -1.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -0.4200 -1.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -4.1070 -0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2330 -4.6420 -0.0630 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0970 -5.0070 -1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0470 -6.3020 -1.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8340 -6.6460 -2.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6810 -5.7050 -3.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7270 -4.4090 -2.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9410 -4.0610 -1.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5170 -6.0740 -4.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3910 -7.2550 -5.0450 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.7710 -4.7930 1.5290 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.6990 -5.9020 1.6280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 -4.7060 2.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7160 -3.3000 1.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 2.0210 -0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 2.1770 -0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3200 2.0590 0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 -0.1160 1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 -2.5630 1.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 -2.2760 -2.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 0.1700 -2.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 -4.4360 -1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -4.5680 0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3960 -7.0460 -1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 -7.6590 -3.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3770 -3.6610 -3.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9860 -3.0460 -1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5780 -3.3170 1.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0630 -3.2770 2.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0880 -2.4310 1.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2800 -5.1760 -5.0690 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 38 2 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 M CHG 1 17 -1 M END